tetrachloro(oxo)molybdenum

• ChemBase ID: 148904
• Molecular Formular: Cl4MoO
• Molecular Mass: 253.7714
• Monoisotopic Mass: 253.77573334
• SMILES: O=[Mo](Cl)(Cl)(Cl)Cl
• Canonical SMILES: Cl[Mo](=O)(Cl)(Cl)Cl
• InChI: InChI=1S/4ClH.Mo.O/h4*1H;;/q;;;;+4;/p-4
• InChIKey: UYEGPKGLVUUIGD-UHFFFAOYSA-J

NAMES AND DATABASE IDS

Names

• IUPAC name: tetrachloro(oxo)molybdenum
• IUPAC Traditional name: MoCl4O
• Synonyms: Molybdenum chloride oxide; Molybdenum oxide chloride; Molybdenum oxytetrachloride; Molybdenum tetrachloride monoxide; Tetrachlorooxomolybdenum; Molybdenum(VI) oxychloride; Molybdenum(VI) tetrachloride oxide; 氯氧化钼(VI); 四氯氧化钼(VI)

Database IDs

• CAS Number: 13814-75-0
• MDL Number: MFCD00014222
• PubChem SID: 162243075; 24863256
• PubChem CID: 4084870

CALCULATED PROPERTIES

• H Acceptors: 1
• H Donor: 0
• LogD (pH = 5.5): 2.1866
• LogD (pH = 7.4): 2.1866
• Log P: 2.1866
• Molar Refractivity: 25.9881 cm^3
• Polarizability: 14.650692 Å^3
• Polar Surface Area: 17.07 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Apperance: powder or crystals

Safety Information

• European Hazard Symbols: Corrosive (C)
• UN Number: 3260
• German water hazard class: 3
• Hazard Class: 8
• Packing Group: 3
• Risk Statements: 34
• Safety Statements: 26-36/37/39-45
• GHS Pictograms: GHS05
• GHS Signal Word: Danger
• GHS Hazard statements: H314
• GHS Precautionary statements: P280-P305 + P351 + P338-P310
• Personal Protective Equipment: Eyeshields, Faceshields, full-face particle respirator type N100 (US), Gloves, respirator cartridge type N100 (US), type P1 (EN143) respirator filter, type P3 (EN 143) respirator cartridges
• RID/ADR: UN 3260 8/PG 3
• Storage Temperature: 2-8°C

Product Information

• Purity: 97%
• Linear Formula: MoOCl4

DETAILS

Sigma Aldrich - 373729

Packaging
5, 25 g in glass bottle
Application
Basis for a novel, binary catalyst for the living polymerization of substituted acetylenes.1